(2S,3S)-2-(aminocarbonylamino)-3-methyl-N-(2-phenylsulfanylethyl)pentanamide

Systemtic Name: (2S,3S)-2-(aminocarbonylamino)-3-methyl-N-(2-phenylsulfanylethyl)pentanamide Openeye Name: (2S,3S)-3-methyl-N-(2-phenylsulfanylethyl)-2-ureido-pentanamide CAS Name: (2S,3S)-2-(carbamoylamino)-3-methyl-N-[2-(phenylthio)ethyl]pentanamide IUPAC Name: (2S,3S)-2-(carbamoylamino)-3-methyl-N-(2-phenylsulfanylethyl)pentanamide Traditional Name: (2S,3S)-3-methyl-N-[2-(phenylthio)ethyl]-2-ureido-valeramide Formula: C15H23N3O2S MolecularWeight: 309.42702

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCCSC1=CC=CC=C1)NC(=O)N

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NCCSC1=CC=CC=C1)NC(=O)N

InChI

InChI=1S/C15H23N3O2S/c1-3-11(2)13(18-15(16)20)14(19)17-9-10-21-12-7-5-4-6-8-12/h4-8,11,13H,3,9-10H2,1-2H3,(H,17,19)(H3,16,18,20)/t11-,13-/m0/s1